TL;DR: 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene (CAS 1614-62-6) is a chemical compound with molecular formula C17H13Br and molecular weight 296.02005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-bromoethylidene)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene
Also Known As: 5-(2-bromoethylidene)-5H-dibenzo[a,d]cycloheptene, 5-(2-BROMO-ETHYLIDENE)-5H-DIBENZO(A,D)CYCLOHEPTENE, 5-(2'-BROMOETHYLIDENE)-5H-DIBENZO[a,d]CYCLOHEPTENE
| Molecular Formula | C17H13Br |
| Molecular Weight | 296.02005 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.02005 Da |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=CC=CC=C3C2=CCBr |
| InChIKey | MQSMPOHUPFYBKF-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene is 1614-62-6.
The molecular formula of 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene is C17H13Br.
The molecular weight of 5-(2-Bromo-ethylidene)-5H-dibenzo(A,D)cycloheptene is 296.02005 g/mol.
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